N-(3-ethanoylphenyl)-4-[(4-pyrrol-1-ylphenyl)methyl]piperidine-1-carboxamide

Systemtic Name: N-(3-ethanoylphenyl)-4-[(4-pyrrol-1-ylphenyl)methyl]piperidine-1-carboxamide Openeye Name: N-(3-acetylphenyl)-4-[(4-pyrrol-1-ylphenyl)methyl]piperidine-1-carboxamide CAS Name: N-(3-acetylphenyl)-4-[[4-(1-pyrrolyl)phenyl]methyl]-1-piperidinecarboxamide IUPAC Name: N-(3-acetylphenyl)-4-[(4-pyrrol-1-ylphenyl)methyl]piperidine-1-carboxamide Traditional Name: N-(3-acetylphenyl)-4-(4-pyrrol-1-ylbenzyl)piperidine-1-carboxamide Formula: C25H27N3O2 MolecularWeight: 401.50078

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Descriptors Computed from Structure

Canonical SMILES:

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCC(CC2)CC3=CC=C(C=C3)N4C=CC=C4

Isomeric SMILES

CC(=O)C1=CC(=CC=C1)NC(=O)N2CCC(CC2)CC3=CC=C(C=C3)N4C=CC=C4

InChI

InChI=1S/C25H27N3O2/c1-19(29)22-5-4-6-23(18-22)26-25(30)28-15-11-21(12-16-28)17-20-7-9-24(10-8-20)27-13-2-3-14-27/h2-10,13-14,18,21H,11-12,15-17H2,1H3,(H,26,30)